5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide

C12H20N4O — CID 23024298

IUPAC5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide
SMILESCCn1nc(C2CCCCC2)c(C(N)=O)c1N
InChIInChI=1S/C12H20N4O/c1-2-16-11(13)9(12(14)17)10(15-16)8-6-4-3-5-7-8/h8H,2-7,13H2,1H3,(H2,14,17)
InChIKeyIDNWOZAIHCSIPX-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.63
Rot. Bonds3

About 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide

5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide (PubChem CID 23024298) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide
PubChem CID23024298
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide
SMILESCCn1nc(C2CCCCC2)c(C(N)=O)c1N
InChIInChI=1S/C12H20N4O/c1-2-16-11(13)9(12(14)17)10(15-16)8-6-4-3-5-7-8/h8H,2-7,13H2,1H3,(H2,14,17)
InChIKeyIDNWOZAIHCSIPX-UHFFFAOYSA-N
XLogP1.63
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide?
The IUPAC name of 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide (CID 23024298) is 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide?
The canonical SMILES for 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide is CCn1nc(C2CCCCC2)c(C(N)=O)c1N.
What is the InChIKey of 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide?
The InChIKey is IDNWOZAIHCSIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-2-16-11(13)9(12(14)17)10(15-16)8-6-4-3-5-7-8/h8H,2-7,13H2,1H3,(H2,14,17).
What are the key properties of 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide?
5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-cyclohexyl-1-ethylpyrazole-4-carboxamide is sourced from PubChem (CID 23024298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).